4-(4,6-BIS(4-((2-ETHYLHEXYLOXY)CARBONYL)PHENYLAMINO)-1,3,5-TRIAZIN-2-YLAMINO)BENZOIC ACID

Details

Stereochemistry	MIXED
Molecular Formula	C40H50N6O6
Molecular Weight	710.8616
Optical Activity	UNSPECIFIED
Defined Stereocenters	0 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-(4,6-BIS(4-((2-ETHYLHEXYLOXY)CARBONYL)PHENYLAMINO)-1,3,5-TRIAZIN-2-YLAMINO)BENZOIC ACID

Structure Search

SMILES

CCCCC(CC)COC(=O)C1=CC=C(NC2=NC(NC3=CC=C(C=C3)C(=O)OCC(CC)CCCC)=NC(NC4=CC=C(C=C4)C(O)=O)=N2)C=C1

InChI

InChIKey=WLBNSNWNKSXJHN-UHFFFAOYSA-N

InChI=1S/C40H50N6O6/c1-5-9-11-27(7-3)25-51-36(49)30-15-21-33(22-16-30)42-39-44-38(41-32-19-13-29(14-20-32)35(47)48)45-40(46-39)43-34-23-17-31(18-24-34)37(50)52-26-28(8-4)12-10-6-2/h13-24,27-28H,5-12,25-26H2,1-4H3,(H,47,48)(H3,41,42,43,44,45,46)

HIDE SMILES / InChI

Approval Year

Name

Type

Language

4-(4,6-BIS(4-((2-ETHYLHEXYLOXY)CARBONYL)PHENYLAMINO)-1,3,5-TRIAZIN-2-YLAMINO)BENZOIC ACID

Systematic Name

English

BENZOIC ACID, 4,4'-((6-((4-CARBOXYPHENYL)AMINO)-1,3,5-TRIAZINE-2,4-DIYL)DIIMINO)BIS-, 1,1'-BIS(2-ETHYLHEXYL) ESTER

Systematic Name

English

ETHYLHEXYL TRIAZONE RELATED COMPOUND B [USP IMPURITY]

Common Name

English

ETHYLHEXYL TRIAZONE RELATED COMPOUND B [USP-RS]

Common Name

English

Code System Code Type Description

FDA UNII

LHA5LZ0JSC

Created by admin on Sat Dec 16 11:28:16 GMT 2023 , Edited by admin on Sat Dec 16 11:28:16 GMT 2023

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PUBCHEM

89869749

Created by admin on Sat Dec 16 11:28:16 GMT 2023 , Edited by admin on Sat Dec 16 11:28:16 GMT 2023

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CAS

1469870-11-8

Created by admin on Sat Dec 16 11:28:16 GMT 2023 , Edited by admin on Sat Dec 16 11:28:16 GMT 2023

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RS_ITEM_NUM

1265559

Created by admin on Sat Dec 16 11:28:16 GMT 2023 , Edited by admin on Sat Dec 16 11:28:16 GMT 2023

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SUBSTANCE RECORD


					LHA5LZ0JSC

4-(4,6-BIS(4-((2-ETHYLHEXYLOXY)CARBONYL)PHENYLAMINO)-1,3,5-TRIAZIN-2-YLAMINO)BENZOIC ACID